Geometry & MOs

Info

ID:	285537
PubChem CID:	104110561
Reduced:	ClNOSC14H20 (1)
Stoich.:	ABCDE14F20 (1)
Weight, g/mol:	267.138992
ΔH_f, kcal/mol:	-70.71
Dipole, Da:	5.69
IP(EA), eV:	-9.26(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chloropentan-2-yl)-2-(3,4-dimethylphenyl)acetamide

Drug info:

PubChemData

Smile

CC(CC(C)Cl)NC(=O)C1=CC2=C(S1)CCCC2

DOS

IR

Vibrations